5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide

C18H20N2O2S3 — CID 50835162

IUPAC5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide
SMILESCCc1ccccc1NS(=O)(=O)c1cc(-c2nc(C)c(C)s2)sc1C
InChIInChI=1S/C18H20N2O2S3/c1-5-14-8-6-7-9-15(14)20-25(21,22)17-10-16(23-13(17)4)18-19-11(2)12(3)24-18/h6-10,20H,5H2,1-4H3
InChIKeyFNAQRYMONOCEKV-UHFFFAOYSA-N
MW392.57 g/mol
LogP5.16
Rot. Bonds5

About 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide

5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide (PubChem CID 50835162) has the molecular formula C18H20N2O2S3 and a molecular weight of 392.57 g/mol. Its IUPAC name is 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide.

Molecular Properties

Compound Name5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide
PubChem CID50835162
Molecular FormulaC18H20N2O2S3
Molecular Weight392.57 g/mol
Exact Mass392.07
IUPAC Name5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide
SMILESCCc1ccccc1NS(=O)(=O)c1cc(-c2nc(C)c(C)s2)sc1C
InChIInChI=1S/C18H20N2O2S3/c1-5-14-8-6-7-9-15(14)20-25(21,22)17-10-16(23-13(17)4)18-19-11(2)12(3)24-18/h6-10,20H,5H2,1-4H3
InChIKeyFNAQRYMONOCEKV-UHFFFAOYSA-N
XLogP5.16
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.57
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methyl-N-(2-phenylpropyl)thiophene-3-sulfonamide
CID 50835080
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-disulfonamide
CID 25048038
N-(2-ethoxyphenyl)-2-methyl-5-(4-methyl-1,3-thiazol-2-yl)thiophene-3-sulfonamide
CID 50835813
N-(2-ethylphenyl)-2-methyl-5-(methylaminomethyl)furan-3-sulfonamide
CID 107522507
N-benzyl-5-(4,5-dimethyl-1,3-thiazol-2-yl)-N,2-dimethylthiophene-3-sulfonamide
CID 50835853
N-cyclohexyl-5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylthiophene-3-sulfonamide
CID 46392966
5-(aminomethyl)-N-(2-ethylphenyl)-2-methylfuran-3-sulfonamide
CID 107536071
N-[(3S)-3-(azepan-1-yl)butyl]-5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylthiophene-3-sulfonamide
CID 92884490
4-chloro-N-(2-ethylphenyl)-2,5-dimethylbenzenesulfonamide
CID 22773817
2-methyl-N-[(2-methylphenyl)methyl]-5-(4-methyl-1,3-thiazol-2-yl)thiophene-3-sulfonamide
CID 50835609
2-bromo-N-(2-ethylphenyl)benzenesulfonamide
CID 26949668
N-(2,5-dimethylphenyl)-5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylthiophene-3-sulfonamide
CID 53041567

Frequently Asked Questions

What is the IUPAC name of 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide?
The IUPAC name of 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide (CID 50835162) is 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide.
What is the SMILES notation for 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide?
The canonical SMILES for 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide is CCc1ccccc1NS(=O)(=O)c1cc(-c2nc(C)c(C)s2)sc1C.
What is the InChIKey of 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide?
The InChIKey is FNAQRYMONOCEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2S3/c1-5-14-8-6-7-9-15(14)20-25(21,22)17-10-16(23-13(17)4)18-19-11(2)12(3)24-18/h6-10,20H,5H2,1-4H3.
What are the key properties of 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide?
5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide has a molecular weight of 392.57 g/mol, XLogP of 5.16, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-ethylphenyl)-2-methylthiophene-3-sulfonamide is sourced from PubChem (CID 50835162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).